AG00GTMN

Name: PD 145305
Brand: Angene Chemical
SKU: AG00GTMN

90536-15-5 | PD 145305

AG00GTMN

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CAS Number	90536-15-5
Catalog Number	AG00GTMN(AGN-PC-00NE2T)
Chemical Name	PD 145305
IUPAC Name	3-phenyl-2-sulfanylpropanoic acid
InChI	InChI=1S/C9H10O2S/c10-9(11)8(12)6-7-4-2-1-3-5-7/h1-5,8,12H,6H2,(H,10,11)
InChI Key	HGIOOMCLOWLFTJ-UHFFFAOYSA-N
MDL Number	MFCD12152788
Molecular Formula	C9H10O2S
Molecular Weight	182.2395
SMILES	C1(=CC=CC=C1)CC(C(=O)O)S
Synonyms	3-phenyl-2-sulfanylpropanoic acid, pd 145305, 90536-15-5, Benzylthioglykolsaure, AC1L1IRG, SCHEMBL498453, CTK8G2287, IN1170, PD-145305, CID4702, 3-phenyl-2-sulfanyl-propanoic Acid,

Complexity	153
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	182.04g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	182.237g/mol
Monoisotopic Mass	182.04g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	38.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.1

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited